CAS
93301-56-5 Purity
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93301-56-5 Purity
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Rollinicin
CAS
93303-16-3
Catalog Number
ACM93303163
Category
Other Products
Molecular Weight
622.92
Molecular Formula
C37H66O7
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Specification
Synonyms
ROLLINICIN;(+)-3-[13-[5'-(1,2-Dihydroxyundecyl)octahydro[2,2'-bifuran]-5-yl]-13-hydroxytridecyl]-5-methyl-2(5H)-furanone
IUPAC Name
4-[13-[5-[5-(1,2-dihydroxyundecyl)oxolan-2-yl]oxolan-2-yl]-13-hydroxytridecyl]-2-methyl-2H-furan-5-one
Canonical SMILES
CCCCCCCCCC(C(C1CCC(O1)C2CCC(O2)C(CCCCCCCCCCCCC3=CC(OC3=O)C)O)O)O
InChI Key
VODBAMRAIJWVTO-UHFFFAOYSA-N
Exact Mass
622.48100
H-Bond Acceptor
7
H-Bond Donor
3
What is the molecular formula of Rollinicin?
The molecular formula of Rollinicin is C37H66O7.
What is the molecular weight of Rollinicin?
The molecular weight of Rollinicin is 622.9 g/mol.
When was Rollinicin created and modified?
Rollinicin was created on March 26, 2005, and modified on December 30, 2023.
Where is Rollinicin found naturally?
Rollinicin is a natural product found in Annona papilionella and Uvaria microcarpa.
What are some synonyms for Rollinicin?
Some synonyms for Rollinicin include ROLLINICIN FR, ROLLINIA PAPILIONELLA, RP-5, B806512K-237, NSC364563, and NSC364954.
What is the IUPAC name of Rollinicin?
The IUPAC name of Rollinicin is 4-[13-[5-[5-(1,2-dihydroxyundecyl)oxolan-2-yl]oxolan-2-yl]-13-hydroxytridecyl]-2-methyl-2H-furan-5-one.
What is the InChI of Rollinicin?
The InChI of Rollinicin is InChI=1S/C37H66O7/c1-3-4-5-6-11-16-19-22-31(39)36(40)35-26-25-34(44-35)33-24-23-32(43-33)30(38)21-18-15-13-10-8-7-9-12-14-17-20-29-27-28(2)42-37(29)41/h27-28,30-36,38-40H,3-26H2,1-2H3.
What is the InChIKey of Rollinicin?
The InChIKey of Rollinicin is VODBAMRAIJWVTO-UHFFFAOYSA-N.
How many hydrogen bond donor counts does Rollinicin have?
Rollinicin has 3 hydrogen bond donor counts.
Is the compound is canonicalized for Rollinicin?
Yes, the compound is canonicalized for Rollinicin.
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