About: [(3S,4aR,6aR,6aR,6bR,8aR,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-yl] acetate

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About: [(3S,4aR,6aR,6aR,6bR,8aR,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-yl] acetate Goto Sponge NotDistinct Permalink

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chemical compound

Attributes	Values
rdf:type	Item
description	composto chimico (it) химическое соединение (ru) chemical compound (en) composé chimique (fr) תרכובת (he) kemisk forbindelse (da) compositum chemicum (la) chemische Verbindung (de) քիմիական միացություն (hy) chemická sloučenina (cs) chemická zlúčenina (sk) chemische verbinding (nl) kemia kombinaĵo (eo) związek chemiczny (pl) chemical compound (en-ca) chemical compound (en-gb) chemiese verbinding (af) chemische Verbindung (de-ch) component quimic (oc) compost químic (ca) composto químico (gl) composto químico (pt) composto químico (pt-br) compuesto quimico (an) compuestu químicu (ast) compus chimic (ro) kemiallinen yhdiste (fi) kjemisk forbindelse (nb) kjemisk sambinding (nn) komponim kimik (sq) konposatu kimiko (eu) senyawa kimia (id) ķīmisks savienojums (lv) хімічна сполука (uk) مركب كيميائي (ar) রাসায়নিক যৌগ (bn) compuesto químico (es) payvastagii khimiyaviy (tg-latn) пайвастагии химиявӣ (tg-cyrl) chemesch Verbindung (lb)
rdfs:label	[(3S,4aR,6aR,6aR,6bR,8aR,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-yl] acetate (en)
skos:prefLabel	[(3S,4aR,6aR,6aR,6bR,8aR,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-yl] acetate (en)
name	[(3S,4aR,6aR,6aR,6bR,8aR,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-yl] acetate (en)
isomeric SMILES	wds:Q105251731-881B688A-ECFA-4DD7-A170-E57136C6606C
stereoisomer of	wds:Q105251731-03604864-C17F-4332-8B5D-9CCBA283B820 wds:Q105251731-2E960AE5-AA83-4A40-9915-50B39F26226B wds:Q105251731-4475586F-4683-4C50-A9F1-D12C0E2ECA8F wds:Q105251731-67EAC6E5-6351-4521-80B3-F9C92DA9CEEB wds:Q105251731-8F015841-F93A-44C9-8F69-16E7FB567937 wds:Q105251731-D5DD86E5-F326-4D1A-A283-56837806EAE4 wds:Q105251731-EAEC541D-84F3-466E-8F40-25234D970E73
isomeric SMILES	C=C1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2[C@@H]1C
stereoisomer of	taraxasterol acetate [(3S,4aR,6aR,6aR,6bR,8aR,12S,12aR,14aS,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-yl] acetate [(3R,4aS,6aR,6aR,6bR,8aR,12S,12aR,14aR,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-yl] acetate [(3R,4aS,6aS,6aS,6bS,8aS,12S,12aR,14aS,14bS)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-yl] acetate [(3S,4aS,6aS,6aR,6bR,8aR,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-yl] acetate [(3R,4aR,6aR,6aR,6bR,8aR,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-yl] acetate [(3S,4aR,6aR,6aR,6bR,8aR,12R,12aS,14aR,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-yl] acetate
instance of	wds:Q105251731-F3B9EFD8-5C38-426B-8F0A-C313F38464E8
instance of	type of chemical entity
subclass of	wds:Q105251731-28D080AB-5279-4F76-9587-F26B370639CF wds:Q105251731-5F7FAF13-6B86-460E-96A0-592874F03869 wds:Q105251731-67D14081-3A9C-4355-8F50-9EB23AD4994E wds:Q105251731-8142A6A7-7210-4CB3-8C7C-C72CCB977C9A
subclass of	Taraxasterol, acetate [(3S,6aR,6aR,6bR,8aR,12aS,14aR,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-yl] acetate (3S,4aR,6bR,8aR,12S,12aR,12bR,14aR,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-hexadecahydropicen-3-yl acetate [(4aR,6aS,6aR,6bR,8aR,12aS,14aS,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-yl] acetate
found in taxon	wds:Q105251731-CAEF98CE-8954-4136-8755-F86ACB3506AB
found in taxon	Koanophyllon villosum
UniChem compound ID	wds:Q105251731-FFA3C683-5F81-4005-AE16-1F19D9D46211
canonical SMILES	wds:Q105251731-EDF7C5AF-DF44-400D-AD8A-0DB2283031E2
InChI	wds:Q105251731-245B6040-052D-4F07-8E9B-242EE7946217
InChIKey	wds:Q105251731-57131FAA-E9BB-498E-833B-0CF80BF7BFB7
chemical formula	wds:Q105251731-F123B337-6F9B-4316-8041-30AF97A37069
PubChem CID	wds:Q105251731-346918EB-B71D-497B-AD70-7FEB65328B87
PubChem CID	http://rdf.ncbi.nlm.nih.gov/pubchem/compound/CID92966441
UniChem compound ID	104502741
canonical SMILES	O=C(OC1CCC2(C)C(CCC3(C)C2CCC4C5C(C(=C)CCC5(C)CCC43C)C)C1(C)C)C
InChI	InChI=1S/C32H52O2/c1-20-12-15-29(6)18-19-31(8)23(27(29)21(20)2)10-11-25-30(7)16-14-26(34-22(3)33)28(4,5)24(30)13-17-32(25,31)9/h21,23-27H,1,10-19H2,2-9H3/t21-,23-,24+,25-,26+,27+,29-,30+,31-,32-/m1/s1
InChIKey	SFEUTIOWNUGQMZ-YIKBINTESA-N
chemical formula	C₃₂H₅₂O₂
PubChem CID	92966441
mass	wds:Q105251731-CF106F88-1898-4BE3-B217-24A6A937ABC9
mass	468.396730904 (xsd:decimal)
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q105251731
is stereoisomer of of	taraxasterol acetate [(3S,4aR,6aR,6aR,6bR,8aR,12S,12aR,14aS,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-yl] acetate [(3R,4aS,6aR,6aR,6bR,8aR,12S,12aR,14aR,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-yl] acetate [(3R,4aS,6aS,6aS,6bS,8aS,12S,12aR,14aS,14bS)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-yl] acetate [(3S,4aS,6aS,6aR,6bR,8aR,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-yl] acetate [(3R,4aR,6aR,6aR,6bR,8aR,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-yl] acetate [(3S,4aR,6aR,6aR,6bR,8aR,12R,12aS,14aR,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-yl] acetate
is stereoisomer of of	wds:Q105251713-27083C99-26DD-42DE-A661-225B9EE22FEA wds:Q27135905-6B8EC184-2022-4057-A3C6-C467E6748917 wds:Q105251719-4924B54B-71EC-4F90-8669-35E8FE86FDF8 wds:Q105251717-964DA32F-AEAD-412D-8D65-994668425C3E wds:Q105251718-AEC040AB-13EB-490E-AAB2-A6C783238951

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