ID: 32005
SMILES:c1(CCCCCC)cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 32006
SMILES:C1(C(C)C)CC=C(C)C2C1c1c(OC)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.524
InChIKey:LLRAHFWMTFITTD-UHFFFAOYSA-N
ID: 32007
SMILES:C12(O)OC(Cc3c4c(cc(CC=C(C)C)c3O)OC(C)(C)C=C4)OC(C)=CC1OC(C)(CC)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.633
CB1 binding score: -14.552
InChIKey:HNEPHPRNCJVNLP-UHFFFAOYSA-N
ID: 32008
SMILES:C1(C)(C)C2C(=O)C=C(C)CC2c2ccc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.015
InChIKey:UQSVQNUIIYZJLG-UHFFFAOYSA-N
ID: 32009
SMILES:Oc1c2c(c(C(CCC)=O)c(O)c1C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.767
InChIKey:FMXWASXJMPBJIG-UHFFFAOYSA-N
ID: 32010
SMILES:CC1(C)Oc2c(c(O)cc(CCCC)c2)C2C=C(C)C(OC(C)=O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.9
InChIKey:XTBDGQPCFGCJFV-UHFFFAOYSA-N
ID: 32011
SMILES:C(=C(CO)C)CC(=O)C1(C)C(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: Not available
InChIKey:GYLYHEOLPUGVAC-UHFFFAOYSA-N
ID: 32012
SMILES:C(CCCC)Cc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -18.043
InChIKey:AELQXIFXNIOWTC-UHFFFAOYSA-N
ID: 32013
SMILES:C1CCC2=C(C1(C)C)C(C)(C)Oc1cc(CCCCC)c(O)c(O)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.212
InChIKey:YYPCWRKJXLWOMJ-UHFFFAOYSA-N
ID: 32014
SMILES:C1(C)=CC(c2c(OC)ccc(CCN(C)C)c2)C(C(C)=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.485
CB1 binding score: -18.294
InChIKey:GJDVDGGMUGCJGX-UHFFFAOYSA-N
ID: 32015
SMILES:CC1C(=O)C2=C(C(O)C1)C(O)(C)c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides
Superclass: Chromanes;Meroterpenoids
Class: Azaphilones;Cannabinoids
MW: 346.423
CB1 binding score: -14.613
InChIKey:MFGGOBVRJJCGQJ-UHFFFAOYSA-N
ID: 32016
SMILES:O(C)c1c2c(cc(CCCCCCCCCC)c1)OC(C)(C)c1ccc(C)cc1-2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -16.338
InChIKey:MMBZFILIMWQFFE-UHFFFAOYSA-N
ID: 32017
SMILES:C1(C(=C)C)C(c2c(O)cc(CCCCO)cc2O)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -12.404
InChIKey:XFVTTZREWFIFHZ-UHFFFAOYSA-N
ID: 32018
SMILES:c1c(CCCCC)cc(O)c2c1OC(C)C1=CCC(C(C)C)=CC1(CC(=O)OC)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -13.653
InChIKey:APJBIVSXCCCWES-UHFFFAOYSA-N
ID: 32019
SMILES:C12C(C)(C)Oc3c(c(O)c(C)c(=O)c(C)c3O)C1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -13.933
InChIKey:KRZNQNQZKAFJJJ-UHFFFAOYSA-N
ID: 32020
SMILES:C1(C)(C)Oc2c(c(O)cc(CCC)c2)C2C1CCC1(C)C(O)CCC(=C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -16.409
InChIKey:WIJBGLVAFGDUCL-UHFFFAOYSA-N
ID: 32021
SMILES:CC(C)=CCCC1=CCC2(C)C(=O)c3c(O)cc(CCCCC)cc3OC2(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -15.482
InChIKey:ZRYMOPWWWYGISB-UHFFFAOYSA-N
ID: 32022
SMILES:OC(c1c(O)c2c(cc1C)OC(C)(C)C1CCC(C)=CC21)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.962
InChIKey:PUCWMLULOFRBGM-UHFFFAOYSA-N
ID: 32023
SMILES:C(c1c(CCC)cc2c(c1O)C1=C(C(C)(C)O2)CC(C(OC)(C)C)O1)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -14.919
InChIKey:OANWWSGXBUSVHL-UHFFFAOYSA-N
ID: 32024
SMILES:C1C(C)=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 32025
SMILES:Oc1ccc2c(c1C)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.767
InChIKey:PAEXFQCXJALBEH-UHFFFAOYSA-N