(Q105237321)

English

(3S,4aR,6aR,6aS,8aS,12aS,14aR,14bS)-8a-(hydroxymethyl)-4,4,6a,6a,11,11,14b-heptamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-ol

chemical compound

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instance of

type of chemical entity

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1 reference

(3S,14bR)-8a-(hydroxymethyl)-4,4,6a,6a,11,11,14b-heptamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-ol

1 reference

based on heuristic

inferred from SMILES

mass

442.38108084 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

(3S,4aS,6aR,6aS,8aS,12aR,14aR,14bR)-8a-(hydroxymethyl)-4,4,6a,6a,11,11,14b-heptamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3R,4aR,6aR,6aS,8aS,12aS,14aR,14bR)-8a-(hydroxymethyl)-4,4,6a,6a,11,11,14b-heptamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3S,4aR,6aR,6aS,8aS,12aS,14aS,14bR)-8a-(hydroxymethyl)-4,4,6a,6a,11,11,14b-heptamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-ol

1 reference

based on heuristic

inferred from InChI

(3R,4aR,6aR,6aS,8aR,12aR,14aR,14bR)-8a-(hydroxymethyl)-4,4,6a,6a,11,11,14b-heptamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-ol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₀H₅₀O₂

0 references

canonical SMILES

OCC12CC=C3C4(C)CCC5C(C)(C)C(O)CCC5(C)C4CCC3(C)C2CC(C)(C)CC1

0 references

isomeric SMILES

CC1(C)CC[C@]2(CO)CC=C3[C@@](C)(CC[C@@H]4[C@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1

0 references

found in taxon

Lithocarpus corneus

1 reference

stated in

Structures of eight new triterpenoids and isolation of other triterpenoids and epi-ikshusterol from the stems of Lithocarpus cornea

Identifiers

InChI

InChI=1S/C30H50O2/c1-25(2)16-17-30(19-31)15-10-22-28(6)12-8-20-26(3,4)24(32)11-14-27(20,5)21(28)9-13-29(22,7)23(30)18-25/h10,20-21,23-24,31-32H,8-9,11-19H2,1-7H3/t20-,21+,23-,24-,27+,28+,29+,30-/m0/s1

0 references

InChIKey

RJAKLUPHSBOQNU-DYFICSMCSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

RJAKLUPHSBOQNU-DYFICSMCSA-N

(Q105237321)

(3S,4aR,6aR,6aS,8aS,12aS,14aR,14bS)-8a-(hydroxymethyl)-4,4,6a,6a,11,11,14b-heptamethyl-1,2,3,4a,5,6,8,9,10,12,12a,13,14,14a-tetradecahydropicen-3-ol

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