Scutebarbatine F
CAS Registry Number®
1207181-62-1
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CAS Name
Scutebarbatine FMolecular Formula
C30H37NO9Molecular Mass
555.62Cite this Page
Scutebarbatine F. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=1207181-62-1 (retrieved ) (CAS RN: 1207181-62-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
130-132 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C30H37NO9/c1-17-9-10-21(39-26(35)20-8-7-13-31-15-20)23-27(4)11-12-30(14-22(34)36-16-30)40-29(27,6)25(38-19(3)33)24(28(17,23)5)37-18(2)32/h7-9,13,15,21,23-25H,10-12,14,16H2,1-6H3/t21-,23-,24+,25+,27-,28+,29+,30+/m1/s1
InChIKey
InChIKey=NVJGRPGPCIYGRC-LZUUMNQWSA-N
SMILES
C[C@@]12[C@@]3([C@@](C)([C@@H](OC(C)=O)[C@H](OC(C)=O)[C@]1(C)O[C@]4(CC2)COC(=O)C4)C(C)=CC[C@H]3OC(=O)C=5C=CC=NC5)[H]
Canonical SMILES
O=C(OC1CC=C(C)C2(C)C(OC(=O)C)C(OC(=O)C)C3(OC4(COC(=O)C4)CCC3(C)C12)C)C=5C=NC=CC5
Other Names for this Substance
- 3-Pyridinecarboxylic acid, (3S,4′aR,5′S,6′R,6′aR,10′R,10′aS,10′bR)-5′,6′-bis(acetyloxy)-1′,2′,4,4′a,5,5′,6′,6′a,9′,10′,10′a,10′b-dodecahydro-4′a,6′a,7′,10′b-tetramethyl-5-oxospiro[furan-3(2H),3′-[3H]naphtho[2,1-b]pyran]-10′-yl ester
- Scutebata F
- Scutebarbatine F
- Barbatine C
Deleted or Replaced CAS Registry Numbers
910099-78-4, 1202356-56-6
