(Q105027502)

English

(3S,6aR,6aS,6bS,8aS,12aR,14aS,14bS)-4,4,6a,6b,8a,11,11,14a-octamethyl-1,2,3,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydropicen-3-ol

chemical compound

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instance of

type of chemical entity

0 references

1 reference

426.38616622 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3S,6aS,6aS,6bR,8aR,12aS,14aR,14bS)-4,4,6a,6b,8a,11,11,14a-octamethyl-1,2,3,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydropicen-3-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3S,6aS,6aR,6bS,8aR,12aR,14aR,14bS)-4,4,6a,6b,8a,11,11,14a-octamethyl-1,2,3,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydropicen-3-ol

2 references

based on heuristic

inferred from InChIKey

1 reference

1 reference

C₃₀H₅₀O

0 references

canonical SMILES

OC1CCC2C(=CCC3C2(C)CCC4(C)C5CC(C)(C)CCC5(C)CCC34C)C1(C)C

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isomeric SMILES

CC1(C)CC[C@@]2(C)CC[C@@]3(C)[C@@H]4CC=C5[C@@H](CC[C@H](O)C5(C)C)[C@@]4(C)CC[C@@]3(C)[C@@H]2C1

0 references

found in taxon

Kalanchoe spathulata

1 reference

stated in

Triterpenoids and sterols of Kalanchoe spathulata

Kalanchoe integra

1 reference

stated in

Triterpenoids and sterols of Kalanchoe spathulata

Kalanchoe deficiens

1 reference

stated in

Triterpenoids and sterols of Kalanchoe spathulata

Kalanchoe lanceolata

1 reference

stated in

Triterpenoids and sterols of Kalanchoe spathulata

Identifiers

InChI

InChI=1S/C30H50O/c1-25(2)13-14-27(5)15-17-29(7)22-11-9-20-21(10-12-24(31)26(20,3)4)28(22,6)16-18-30(29,8)23(27)19-25/h9,21-24,31H,10-19H2,1-8H3/t21-,22-,23-,24+,27+,28-,29+,30+/m1/s1

0 references

InChIKey

HFSACQSILLSUII-MIVWZROKSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

HFSACQSILLSUII-MIVWZROKSA-N

(Q105027502)

(3S,6aR,6aS,6bS,8aS,12aR,14aS,14bS)-4,4,6a,6b,8a,11,11,14a-octamethyl-1,2,3,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydropicen-3-ol

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Identifiers

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