CompoundList
Sign in
Steroids and sterols

16alpha-Hydroxyasclepin

CAS 121007-12-3Formula C31H42O11Molar mass 590.67 g/mol
Get quotes Safety data
16alpha-Hydroxyasclepin chemical structure, C31H42O11, CAS 121007-12-3
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
121007-12-3
Formula
C31H42O11
Molar mass
590.67 g/mol
HS code
293220
Category
Steroids and sterols

What is 16alpha-Hydroxyasclepin?

Plain description, key identifiers and synonyms

16alpha-Hydroxyasclepin has been reported in Asclepias vestita and Asclepias curassavica.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
[(1S,3R,5S,7R,9S,10S,12R,14R,15S,18R,19R,20R,22S,23R)-14-formyl-10,20,22-trihydroxy-7,18-dimethyl-19-(5-oxo-2H-furan-3-yl)-4,6,11-trioxahexacyclo[12.11.0.03,12.05,10.015,23.018,22]pentacosan-9-yl] acetate
CAS number
121007-12-3
Molecular formula
C31H42O11
InChIKey
WUKLZVMMOYZVQR-MVELXVHSSA-N
InChI
InChI=1S/C31H42O11/c1-15-8-24(40-16(2)33)31(37)27(39-15)41-22-10-18-4-5-20-19(29(18,14-32)12-23(22)42-31)6-7-28(3)26(17-9-25(35)38-13-17)21(34)11-30(20,28)36/h9,14-15,18-24,26-27,34,36-37H,4-8,10-13H2,1-3H3/t15-,18+,19+,20-,21-,22-,23-,24+,26+,27+,28-,29-,30+,31+/m1/s1
Canonical SMILES
CC(=O)OC1CC(C)OC2OC3CC4CCC5C(CCC6(C)C(C7=CC(=O)OC7)C(O)CC56O)C4(C=O)CC3OC12O
Isomeric SMILES
C[C@@H]1C[C@@H]([C@]2([C@@H](O1)O[C@@H]3C[C@@H]4CC[C@@H]5[C@@H]([C@]4(C[C@H]3O2)C=O)CC[C@]6([C@@]5(C[C@H]([C@@H]6C7=CC(=O)OC7)O)O)C)O)OC(=O)C

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
590.67 g/molcalc.
Exact mass
590.2727 Dacalc.
LogP (octanol/water)
1.54calc.
Topological polar surface area
158.1 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
11calc.
Rotatable bonds
3calc.
Heavy atoms
42calc.
Rings
7calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.84calc.
Formal charge
0calc.
Stereocentres
14calc.
Lipinski rule of five
Fails (2 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, O=C1C=C(C2CCC3C2CCC2C4CC5OC6CCCOC6OC5CC4CCC23)CO1

O=C1C=C(C2CCC3C2CCC2C4CC5OC6CCCOC6OC5CC4CCC23)CO1

7 rings, 31 atoms.

11 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

16alpha-Hydroxyasclepin suppliers

Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings

No supplier listings yet

Post one free request and suppliers who make or trade 16alpha-Hydroxyasclepin can send you quotes. Your contact details stay private until you accept a quote.

Request quotesSell this chemical

16alpha-Hydroxyasclepin price

Indicative price range per kg from live supplier offers

No published prices right now

Suppliers quote this chemical on request. Send one free request and compare quotes side by side.

Get latest price

Uses and applications

What the substance is used for, by industry and function

Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code 16alpha-Hydroxyasclepin is traded under.

HS 2932.20Indicative HS code

Lactones

World exports in 2024
$1.97B
−4.7% vs 2023, imports $2.07B
2019 to 2024
Top exporters
  1. China56.3%
  2. India * partner reported7.4%
  3. Germany7.3%
Top importers
  1. United States14.2%
  2. India * partner reported13.5%
  3. Brazil8.5%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for 16alpha-Hydroxyasclepin is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about 16alpha-Hydroxyasclepin, based on the data on this page

What is 16alpha-Hydroxyasclepin?

16alpha-Hydroxyasclepin has been reported in Asclepias vestita and Asclepias curassavica.

What is the CAS number of 16alpha-Hydroxyasclepin?

The CAS registry number of 16alpha-Hydroxyasclepin is 121007-12-3.

What is the molecular formula and weight of 16alpha-Hydroxyasclepin?

The molecular formula of 16alpha-Hydroxyasclepin is C31H42O11 and its molar mass is 590.67 g/mol.

Is 16alpha-Hydroxyasclepin hazardous?

No GHS hazard classification for 16alpha-Hydroxyasclepin is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of 16alpha-Hydroxyasclepin?

16alpha-Hydroxyasclepin is usually classified under HS code 293220 (Lactones). This is indicative, confirm it with your customs broker before shipping.

Where can I buy 16alpha-Hydroxyasclepin?

Post a free request on CompoundList and suppliers of 16alpha-Hydroxyasclepin will send you quotes. Your contact details stay private until you accept a quote.

What is the price of 16alpha-Hydroxyasclepin?

Suppliers quote 16alpha-Hydroxyasclepin on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle 16alpha-Hydroxyasclepin

Get quotes for 16alpha-Hydroxyasclepin

Post one free request with your grade, quantity and destination. Matching suppliers send quotes you can compare side by side.
Post a request Sell 16alpha-Hydroxyasclepin
Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
Embed this structure on your websiteShow code

Paste this code into your page to show the 2D structure of 16alpha-Hydroxyasclepin with a 3D view, its CAS number where known and a link back to this page. Free to use with the link kept.

<iframe src="https://www.compoundlist.com/embed/structure/16alpha-hydroxyasclepin-121007-12-3" title="16alpha-Hydroxyasclepin structure on CompoundList" width="360" height="420" style="border:1px solid #E7E2DA;border-radius:12px;max-width:100%" loading="lazy" referrerpolicy="strict-origin-when-cross-origin"></iframe>
Preview the embed

Explore more in Steroids and sterols or HS code 293220

Price on request
Free quotes, contact stays private
Get quotes