(Q104253521)

English

(3R,3aR,5aS,7aS,11aS,11bR,13aS,13bR)-3a,5a,8,8,11a,13a-hexamethyl-3-propan-2-yl-1,2,3,4,5,7,7a,9,10,11,11b,12,13,13b-tetradecahydrocyclopenta[a]chrysene

chemical compound

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instance of

type of chemical entity

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subclass of

3a,5a,8,8,11a,13a-Hexamethyl-3-propan-2-yl-1,2,3,4,5,7,7a,9,10,11,11b,12,13,13b-tetradecahydrocyclopenta[a]chrysene

1 reference

based on heuristic

inferred from SMILES

mass

410.3912516 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3R,3aR,5aS,7aS,11aS,11bR,13aS,13bS)-3a,5a,8,8,11a,13a-hexamethyl-3-propan-2-yl-1,2,3,4,5,7,7a,9,10,11,11b,12,13,13b-tetradecahydrocyclopenta[a]chrysene

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(3R,3aR,5aS,7aR,11aS,11bR,13aS,13bS)-3a,5a,8,8,11a,13a-hexamethyl-3-propan-2-yl-1,2,3,4,5,7,7a,9,10,11,11b,12,13,13b-tetradecahydrocyclopenta[a]chrysene

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₀H₅₀

0 references

canonical SMILES

C1=C2C(CCC3(C)C4CCC(C(C)C)C4(C)CCC23C)C5(C)CCCC(C)(C)C5C1

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isomeric SMILES

CC(C)[C@H]1CC[C@H]2[C@]3(C)CC[C@H]4C(=CC[C@H]5C(C)(C)CCC[C@@]54C)[C@@]3(C)CC[C@]12C

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found in taxon

Cyathea dealbata

1 reference

stated in

Wax esters of the new zealand silver fern, Cyathea dealbata

Polypodium subpetiolatum

1 reference

stated in

Nonpolar Pentacyclic Triterpenes of the Medicinal Fern Polypodium subpetiolatum

Adiantum capillus-veneris

4 references

stated in

Fern Constituents: Six New Triterpenoid Alcohols from Adiantum capillus-veneris.

stated in

Fern constituents: triterpenoids from Adiantum capillus-veneris

stated in

Fern Constituents: Six New Triterpenoid Alcohols from Adiantum capillus-veneris.

stated in

Fern constituents: triterpenoids from Adiantum capillus-veneris

Adiantum caudatum

2 references

stated in

Triterpenoids from Adiantum caudatum

stated in

Triterpenoids from Adiantum caudatum

Adiantum raddianum

1 reference

stated in

Fern Constituents: Adiantum cuneatum. I. Three New Triterpenoids, Glaucanol B Acetate, 7.BETA.,25-Epoxyfern-8-ene and 25-Norfern-7-en-10.BETA.-yl Formate.

Adiantum edgeworthii

2 references

stated in

Fern Constituents: Triterpenoids Isolated from the Leaves of Adiantum edgeworthii. Structures of 19.ALPHA.-Hydroxyadiantone and Fern-9(11)-en-25-oic Acid.

stated in

Fern Constituents: Triterpenoids Isolated from the Leaves of Adiantum edgeworthii. Structures of 19.ALPHA.-Hydroxyadiantone and Fern-9(11)-en-25-oic Acid.

Adiantum pedatum

1 reference

stated in

Fern Constituents: Triterpenoids Isolated from the Leaves of Adiantum pedatum. 23-Hydroxyfernene, Glaucanol A and filicenoic Acid.

Cheiropleuria bicuspis

1 reference

stated in

Fern constituents: Triterpenoids isolated from the leaves of Cheiropleuria bicuspis.

Alsophila lepifera

1 reference

stated in

Fern Constituents: Triterpenoids Isolated from Leaflets of Cyathea lepife.

Cyathea lepifera

1 reference

stated in

Fern Constituents: Triterpenoids Isolated from Leaflets of Cyathea lepife.

Davallia mariesii

2 references

stated in

Fern constituents: Two new triterpenoid hydrocarbons, hop-16-ene and isohop-22(29)-ene, isolated from Davallia mariesii.

stated in

Fern constituents: Two new triterpenoid hydrocarbons, hop-16-ene and isohop-22(29)-ene, isolated from Davallia mariesii.

Oleandra wallichii

1 reference

stated in

Fern Constituents : Triterpenoids from Oleandra wallichii

Polypodium vulgare

1 reference

stated in

Fern constituents: Cyclopodmenyl acetate, a cycloartanoid having a new 33-carbon skeleton, isolated from Polypodium vulgare.

Goniophlebium mengtzeense

1 reference

stated in

Triterpenoids from the fern Goniophlebium mengtzeense

Aleuritopteris mexicana

1 reference

stated in

Fern Constituents: Sesterterpenoids Isolated from Fronds of Aleuritopteris mexicana.

Lindsaea trichomanoides

1 reference

stated in

Fern Constituents: Adiantum cuneatum. I. Three New Triterpenoids, Glaucanol B Acetate, 7.BETA.,25-Epoxyfern-8-ene and 25-Norfern-7-en-10.BETA.-yl Formate.

Davallia bullata

1 reference

stated in

Fern constituents: Two new triterpenoid hydrocarbons, hop-16-ene and isohop-22(29)-ene, isolated from Davallia mariesii.

Davallia trichomanoides

1 reference

stated in

Fern constituents: Two new triterpenoid hydrocarbons, hop-16-ene and isohop-22(29)-ene, isolated from Davallia mariesii.

Goniophlebium formosanum

1 reference

stated in

Fern constituents: pentacyclic triterpenoids isolated from Polypodium niponicum and P. formosanum

Polypodium virginianum

1 reference

stated in

Fern constituents: Cyclopodmenyl acetate, a cycloartanoid having a new 33-carbon skeleton, isolated from Polypodium vulgare.

Goniophlebium niponicum

1 reference

stated in

Fern constituents: pentacyclic triterpenoids isolated from Polypodium niponicum and P. formosanum

Adiantum abscissum

1 reference

stated in

Fern Constituents: Adiantum cuneatum. I. Three New Triterpenoids, Glaucanol B Acetate, 7.BETA.,25-Epoxyfern-8-ene and 25-Norfern-7-en-10.BETA.-yl Formate.

Identifiers

InChI

InChI=1S/C30H50/c1-20(2)21-10-13-25-28(21,6)18-19-29(7)23-11-12-24-26(3,4)15-9-16-27(24,5)22(23)14-17-30(25,29)8/h11,20-22,24-25H,9-10,12-19H2,1-8H3/t21-,22+,24+,25-,27-,28-,29-,30+/m1/s1

0 references

InChIKey

NYHSEYGDWZMIEZ-YGQXTZRHSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

NYHSEYGDWZMIEZ-YGQXTZRHSA-N

1 reference

(Q104253521)

(3R,3aR,5aS,7aS,11aS,11bR,13aS,13bR)-3a,5a,8,8,11a,13a-hexamethyl-3-propan-2-yl-1,2,3,4,5,7,7a,9,10,11,11b,12,13,13b-tetradecahydrocyclopenta[a]chrysene

Statements

Identifiers

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