2H-1-Benzopyrano[5′,6′:6,7]indeno[1,2-b]indol-3(4bH)-one, 5,6,6a,7,12,12b,12c,13,14,14a-decahydro-14a-hydroxy-2-(1-hydroxy-1-methylethyl)-12b,12c-dimethyl-, [2R-(2α,4bβ,6aα,12bβ,12cα,14aβ)]-

CAS Registry Number®

157530-29-5

CAS Name

2H-1-Benzopyrano[5′,6′:6,7]indeno[1,2-b]indol-3(4bH)-one, 5,6,6a,7,12,12b,12c,13,14,14a-decahydro-14a-hydroxy-2-(1-hydroxy-1-methylethyl)-12b,12c-dimethyl-, [2R-(2α,4bβ,6aα,12bβ,12cα,14aβ)]-

Molecular Formula

C27H33NO4

Molecular Mass

435.56

Cite this Page

2H-1-Benzopyrano[5′,6′:6,7]indeno[1,2-b]indol-3(4bH)-one, 5,6,6a,7,12,12b,12c,13,14,14a-decahydro-14a-hydroxy-2-(1-hydroxy-1-methylethyl)-12b,12c-dimethyl-, [2R-(2α,4bβ,6aα,12bβ,12cα,14aβ)]-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=157530-29-5 (retrieved 2024-11-21) (CAS RN: 157530-29-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H33NO4/c1-24(2,30)23-21(29)14-19-18-10-9-15-13-17-16-7-5-6-8-20(16)28-22(17)26(15,4)25(18,3)11-12-27(19,31)32-23/h5-8,14-15,18,23,28,30-31H,9-13H2,1-4H3/t15-,18-,23-,25-,26+,27-/m0/s1

InChIKey

InChIKey=JFVYPWSFDLYZKB-XTHGXZEWSA-N

SMILES

C[C@@]12[C@]3(C)[C@](C=4[C@](O)(CC3)O[C@H](C(C)(C)O)C(=O)C4)(CC[C@]1(CC5=C2NC=6C5=CC=CC6)[H])[H]

Canonical SMILES

O=C1C=C2C3CCC4CC=5C=6C=CC=CC6NC5C4(C)C3(C)CCC2(O)OC1C(O)(C)C

Other Names for this Substance

  • 2H-1-Benzopyrano[5′,6′:6,7]indeno[1,2-b]indol-3(4bH)-one, 5,6,6a,7,12,12b,12c,13,14,14a-decahydro-14a-hydroxy-2-(1-hydroxy-1-methylethyl)-12b,12c-dimethyl-, [2R-(2α,4bβ,6aα,12bβ,12cα,14aβ)]-
  • 7-Hydroxy-13-dehydroxypaxilline