(Q105279311)

English

(4aR,6aS,6aR,6bS,12aS,14aS,14bS)-4,11-dihydroxy-2,4a,6a,6a,9,14a-hexamethyl-1,2,4,5,6,6b,7,8,11,12,12a,13,14,14b-tetradecahydropicene-3,10-dione

group of stereoisomers with the chemical formula C₂₈H₄₂O₄

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

442.30830982399993 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₈H₄₂O₄

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canonical SMILES

O=C1C(=C2CCC3C(C)(CCC4(C)C5CC(C(=O)C(O)C5(C)CCC34C)C)C2CC1O)C

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isomeric SMILES

CC1=C2CC[C@H]3[C@@](C)(CC[C@@]4(C)[C@@H]5CC(C)C(=O)C(O)[C@]5(C)CC[C@]34C)[C@@H]2CC(O)C1=O

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found in taxon

Tripterygium wilfordii

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stated in

A novel epoxy-triterpene and nortriterpene from callus cultures of Tripterygium wilfordii

Salacia chinensis

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stated in

Structures of new friedelane- and norfriedelane-type triterpenes and polyacylated eudesmane-type sesquiterpene from Salacia chinensis LINN. (S. prinoides DC., Hippocrateaceae) and radical scavenging activities of principal constituents

Identifiers

InChI

InChI=1S/C28H42O4/c1-15-13-21-26(4,24(32)22(15)30)10-12-27(5)20-8-7-17-16(2)23(31)19(29)14-18(17)25(20,3)9-11-28(21,27)6/h15,18-21,24,29,32H,7-14H2,1-6H3/t15?,18-,19?,20+,21-,24?,25+,26-,27-,28+/m1/s1

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InChIKey

UUGCGHAFZPEHIC-XBECROFOSA-N

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2 references

6 January 2023

inferred from InChIKey

matched by identifier from

InChIKey

UUGCGHAFZPEHIC-XBECROFOSA-N

1 reference

(Q105279311)

(4aR,6aS,6aR,6bS,12aS,14aS,14bS)-4,11-dihydroxy-2,4a,6a,6a,9,14a-hexamethyl-1,2,4,5,6,6b,7,8,11,12,12a,13,14,14b-tetradecahydropicene-3,10-dione

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