ID: 43639
SMILES:OC(=O)C(C)Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.545
InChIKey:FDMTTXHQTVBXFR-UHFFFAOYSA-N
ID: 43640
SMILES:C=C1CC2CC1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.74
InChIKey:RMFSHKUIJROHSD-UHFFFAOYSA-N
ID: 43641
SMILES:C(CCC)c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 43642
SMILES:C(CCCC)CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.687
InChIKey:RGXKCMQANRHRCO-UHFFFAOYSA-N
ID: 43643
SMILES:C(C)CCc1cc(O)c(CC=C(C)C)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -19.084
InChIKey:DOQHJUXXWKEFSQ-UHFFFAOYSA-N
ID: 43644
SMILES:C1(O)C(C)=CC(c2ccc(CCCCC)cc2)C(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -17.085
InChIKey:VUDSKIPMWGVGSR-UHFFFAOYSA-N
ID: 43645
SMILES:C1C2(C)CC(c3c(O)cc(CCCCC)cc3O1)OC1C(CCCC1)=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.327
InChIKey:BARXDHZPGMXSJW-UHFFFAOYSA-N
ID: 43646
SMILES:c1(O)c(C(C(C)=C)C(=O)C)cc2c(c1OC)OC(C)(C)C1CCC(CCCCCCCCCC)C1(C)C2O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 528.774
CB1 binding score: -14.146
InChIKey:WTAUSCYZYVCXCG-UHFFFAOYSA-N
ID: 43647
SMILES:C12=C(c3c(cc(CCCCC)cc3O)OC1(C)C)CC(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.813
InChIKey:DCDPNMVODDBSDR-UHFFFAOYSA-N
ID: 43648
SMILES:Oc1cc(CCCCC)cc2c1-c1ccccc1CCOC(=O)C(=CCCC(C)(O)C=C)CO2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.602
CB1 binding score: -15.796
InChIKey:SKCPBHSFDYUJEW-UHFFFAOYSA-N
ID: 43649
SMILES:C1(C)=CC2(c3c(O)cc(CCCC=CCC)cc3OC2(C)C)C(O)C2(O)C1OC(=O)C2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.536
CB1 binding score: -14.498
InChIKey:NRHOTKIQQJPOIT-UHFFFAOYSA-N
ID: 43650
SMILES:C1CCC2(C)Oc3c(c(O)cc(CCCCC)c3)C3C2C1OC3=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: Not available
InChIKey:RGJJNFWONUUQAB-UHFFFAOYSA-N
ID: 43651
SMILES:OCC1=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -17.888
InChIKey:PQLHCGPBCSGLBO-UHFFFAOYSA-N
ID: 43652
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C(CO)(C)O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 280.364
CB1 binding score: -16.034
InChIKey:JJACNFMABFTJPW-UHFFFAOYSA-N
ID: 43653
SMILES:c1c(O)c(C(C=C(C)C)=O)c(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -16.085
InChIKey:AKHKRLOHOJZTHY-UHFFFAOYSA-N
ID: 43654
SMILES:Cc1cc(O)c2c(c1)OC1(C)C2C2C(C2(CCC=C(C)CO)COC(C)=O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -15.754
InChIKey:KHJVINHNYXWRLZ-UHFFFAOYSA-N
ID: 43655
SMILES:Oc1c(C(C)C(OC(=O)C)C(C)C)c2c(c(O)c1)C1C(C(C)(C)O2)OC(C)(C)C(Cl)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.991
CB1 binding score: -14.967
InChIKey:BKQVBPBCRCRNBH-UHFFFAOYSA-N
ID: 43656
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 43657
SMILES:C1(C)=CC(c2cc(CCCCC)cc(OC)c2O)C(C(CCCC(C)C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.647
CB1 binding score: -14.751
InChIKey:CKWLZUPFKUVFAP-UHFFFAOYSA-N
ID: 43658
SMILES:C1C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C(=O)C=C2C(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -15.192
InChIKey:KOQUCSWJAWKUNC-UHFFFAOYSA-N
ID: 43659
SMILES:C(CCCOCCC)c1c2c3c(cc1)OC(C)(C)C1C3CC(C)(C2)OC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -12.737
InChIKey:LUBXHSPGWQGIGD-UHFFFAOYSA-N