Norstaminolactone
AlkaPlorer ID: AK089612
Synonym: None
IUPAC Name: [(1S,2R,4S,6S,7S,8R,9S,10S,11R,12S,13R)-2,7-diacetyloxy-8-benzoyloxy-6-hydroxy-5,5,9,13-tetramethyl-12-(methylaminomethyl)-14-oxo-15,16-dioxatetracyclo[11.2.1.01,10.04,9]hexadecan-11-yl] benzoate
Structure
SMILES: CNC[C@H]1[C@@H](OC(=O)C2=CC=CC=C2)[C@H]2[C@]3(OC(=O)[C@]1(C)O3)[C@H](OC(C)=O)C[C@H]1C(C)(C)[C@H](O)[C@H](OC(C)=O)[C@H](OC(=O)C3=CC=CC=C3)[C@@]12C
InChI: InChI=1S/C38H45NO12/c1-20(40)46-26-18-25-35(3,4)30(42)28(47-21(2)41)31(49-33(44)23-16-12-9-13-17-23)36(25,5)29-27(48-32(43)22-14-10-8-11-15-22)24(19-39-7)37(6)34(45)50-38(26,29)51-37/h8-17,24-31,39,42H,18-19H2,1-7H3/t24-,25-,26+,27+,28-,29+,30+,31-,36-,37+,38-/m0/s1
InChIKey: HBQNTFBQEGIAOY-CWUCWMPNSA-N
Reference
Norstaminane- and isopimarane-type diterpenes of Orthosiphon stamineus from Okinawa
PubChem CID: 11146922
LOTUS: LTS0159415
SuperNatural Ⅲ: SN0121185-01
NPASS: NPC133217
Source
Properties Information
Molecule Weight: 707.7730000000003
TPSA?: 172.98999999999998
MolLogP?: 3.221700000000001
Number of H-Donors: 2
Number of H-Acceptors: 13
RingCount: 6
Activities Information
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