(Q104980411)

English

(4R,4aR,6R,6aS,6aS,6bS,8aR,12aR,14aS,14bR)-6-hydroxy-6b-(hydroxymethyl)-4,4a,6a,8a,11,11,14a-heptamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

6-hydroxy-6b-(hydroxymethyl)-4,4a,6a,8a,11,11,14a-heptamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one

1 reference

based on heuristic

inferred from SMILES

mass

458.37599546 dalton

1 reference

1 reference

C₃₀H₅₀O₃

0 references

canonical SMILES

O=C1CCC2C3(C)CCC4(C)C5CC(C)(C)CCC5(C)CCC4(CO)C3C(O)CC2(C)C1C

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isomeric SMILES

C[C@H]1C(=O)CC[C@@H]2[C@]3(C)CC[C@@]4(C)[C@@H]5CC(C)(C)CC[C@]5(C)CC[C@]4(CO)[C@H]3[C@H](O)C[C@@]12C

0 references

found in taxon

Salacia chinensis

1 reference

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/C30H50O3/c1-19-20(32)8-9-22-27(5)13-14-29(7)23-17-25(2,3)10-11-26(23,4)12-15-30(29,18-31)24(27)21(33)16-28(19,22)6/h19,21-24,31,33H,8-18H2,1-7H3/t19-,21+,22+,23+,24-,26+,27-,28-,29-,30-/m0/s1

0 references

InChIKey

DHNJMOPCFKWKNM-DPCKGMBMSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

DHNJMOPCFKWKNM-DPCKGMBMSA-N

(Q104980411)

(4R,4aR,6R,6aS,6aS,6bS,8aR,12aR,14aS,14bR)-6-hydroxy-6b-(hydroxymethyl)-4,4a,6a,8a,11,11,14a-heptamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one

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