ID: 93619
SMILES:C1(CO)(c2c(OC(=O)C(C)C)cc(COC(=O)CC(C)(C)OC(=O)C)cc2)CCC(O)C(C)(C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.581
CB1 binding score: -16.339
InChIKey:LQAVXXDPVLHHHN-UHFFFAOYSA-N
ID: 93620
SMILES:CC(=C)C1CC(C)C(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.934
InChIKey:MCPDCJCMQAMOHS-UHFFFAOYSA-N
ID: 93621
SMILES:CC1(C)Oc2c(c(O)cc(CCC)c2)C2C1CCC1(C)C(=O)CC(O)C(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.527
InChIKey:ZUBVVUQRLCSLCM-UHFFFAOYSA-N
ID: 93622
SMILES:C1C(C(=C)C)C2c3c(O)cc(CCCCC)cc3OC(CCC=C(C)C)(C2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.963
InChIKey:HTHFXYFYBKUYLG-UHFFFAOYSA-N
ID: 93623
SMILES:C1(C)CC2=C(C(C)(C)Oc3c2c(O)cc(C)c3)CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -15.757
InChIKey:HTPAWAXOPGERAF-UHFFFAOYSA-N
ID: 93624
SMILES:C=C(C)C1C(c2cc(CCCCC)ccc2O)C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.847
InChIKey:WCSIJTNFNFVEGE-UHFFFAOYSA-N
ID: 93625
SMILES:c1(CCCCC)c(OC)c(O)cc2c1-c1cc3c(cc1CC(C)(C)C2)OC(C)(C)C1C3C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.711
CB1 binding score: -15.599
InChIKey:CJOONYPQNNPVSR-UHFFFAOYSA-N
ID: 93626
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)c1c-2c(O)c2c(c1)C1=C(C(O)(CCC=C(CCC=C(C)C)C)C)CC1O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 556.787
CB1 binding score: -16.537
InChIKey:USQZVAROFLWONV-UHFFFAOYSA-N
ID: 93627
SMILES:c1(C(OC)=O)c(O)cc(CCCCC)c(C2C(C(C)C)CCC(C)=C2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 358.522
CB1 binding score: -15.36
InChIKey:KTPHOJOMWBBIGW-UHFFFAOYSA-N
ID: 93628
SMILES:c1(O)c2c(cc(O)c1)OC(C)(C)CC1=C2C(C)CCC1=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -16.38
InChIKey:SPUDWYMDNYEOSJ-UHFFFAOYSA-N
ID: 93629
SMILES:c1(CCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)C(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -18.721
InChIKey:ULZHEUZUAQGXNB-UHFFFAOYSA-N
ID: 93630
SMILES:C(C)(=CCC1C(C)(C2C=C(C)CCC2C(C=O)C)Oc2c(c(O)cc(CCC)c2)C1=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: Not available
InChIKey:HBOLQCTVECYPOR-UHFFFAOYSA-N
ID: 93631
SMILES:C1C2C(C(O)=O)(c3c(OC)cc(CCCCC)cc3OC2(C)C)CC(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -14.296
InChIKey:UAWHWNXCPSWBAH-UHFFFAOYSA-N
ID: 93632
SMILES:C1=C(C)CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 93633
SMILES:C(C)CCCCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 93634
SMILES:C(CC(c1c(O)cc(CCCCC)cc1O)=O)(O)=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.718
InChIKey:RARUNBJPPYFBCX-UHFFFAOYSA-N
ID: 93635
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 93636
SMILES:CC(=CCCC(=CCc1c(O)cc(CCC)cc1O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 93637
SMILES:C(=CCCC1(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c2C=C1)(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -17.872
InChIKey:PIWDPVFUVKGKSR-UHFFFAOYSA-N
ID: 93638
SMILES:C12c3c(cc(CCC)cc3O)OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 93639
SMILES:c1c(O)c2c(cc1CCCCC)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N