ID: 72472
SMILES:CCCCCc1c(C(O)=O)cc2c(c1O)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.491
InChIKey:ZDSCGPKQNSXTPX-UHFFFAOYSA-N
ID: 72473
SMILES:c12ccc(CCCCCC)cc1OCC2CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.459
CB1 binding score: -16.938
InChIKey:HLSFAWLJRNZUSX-UHFFFAOYSA-N
ID: 72474
SMILES:c1(C)c2c(c(CC=C(C)C)cc1O)C(=O)c1cc(C)ccc1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.458
CB1 binding score: -16.226
InChIKey:HOZUXYCXFGMEGZ-UHFFFAOYSA-N
ID: 72475
SMILES:C1C(C)C(C(OC)=O)C(C)(C)CC1c1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -15.805
InChIKey:GEKDYYGKXXEGPI-UHFFFAOYSA-N
ID: 72476
SMILES:c1(C)c(O)c(Oc2c(CC=C(C)CCC=C(C)CCC=C(C)C)c(O)cc(CCCCC)c2)ccc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.727
CB1 binding score: -14.419
InChIKey:HXOACFBFKIBYKF-UHFFFAOYSA-N
ID: 72477
SMILES:CC(c1c(O)c(C(=O)O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.907
InChIKey:GLHDXMQTVOJMKT-UHFFFAOYSA-N
ID: 72478
SMILES:C1CC2(C)C(Oc3c2c(O)cc(CCCCC)c3)C2C3C(C(C)C=C2C1(O)C)OC(C)(C)C3O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.65
CB1 binding score: -10.804
InChIKey:MQFLXNDVTNYKID-UHFFFAOYSA-N
ID: 72479
SMILES:CC(CCC=C(C)C)=CCc1c(O)c(C(O)=O)c(CCCCC)c(O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -17.138
InChIKey:BZHWTNCHQIQETM-UHFFFAOYSA-N
ID: 72480
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC=CCCCCC(CC=CC(O)=O)=O)c2)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -12.243
InChIKey:SVXKNOZFTHZXJU-UHFFFAOYSA-N
ID: 72481
SMILES:C1C(C)=CC2C(C(C)(C)Oc3c(C=O)c(O)c(C(OC)=O)cc32)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.38
CB1 binding score: -15.892
InChIKey:OVPGTBSMQJBHGP-UHFFFAOYSA-N
ID: 72482
SMILES:C(=O)(Oc1cc(CCCCC)cc(O)c1C1C(O)C(O)C(OC)C(O)C1C)C=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.545
CB1 binding score: -15.349
InChIKey:RIVOXLULKWGKAE-UHFFFAOYSA-N
ID: 72483
SMILES:Oc1cc(CCCCC)cc2c1C1=C(CCC(C)(C)O1)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -12.352
InChIKey:VJUJNBNFZCEKDF-UHFFFAOYSA-N
ID: 72484
SMILES:C1(=O)C(C)=CC(c2c(O)cc(CCC(O)CC)cc2O)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.678
InChIKey:OZOUXESFBUALCR-UHFFFAOYSA-N
ID: 72485
SMILES:OC1C(O)C(O)C(CO)OC1Oc1cc(CCCCC)cc2c1C1C(C(C)(C)O2)CC(C(O)(C)C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 510.624
CB1 binding score: -16.053
InChIKey:SNISXSZEXUMMBO-UHFFFAOYSA-N
ID: 72486
SMILES:C(Cc1c(O)cc(CCCCC)cc1O)=C(C#CC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.546
InChIKey:YCELLFDLZMVNRE-UHFFFAOYSA-N
ID: 72487
SMILES:c12cc(CCCCC)cc(OC)c1OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.67
InChIKey:GDMUINYFEZQOOV-UHFFFAOYSA-N
ID: 72488
SMILES:C1(O)CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.143
InChIKey:CIVSDEYXXUHBPV-UHFFFAOYSA-N
ID: 72489
SMILES:c1(O)c(C)cc(C(C(C)C)CC)cc1-c1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(CCC=C(C)C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 502.739
CB1 binding score: -12.978
InChIKey:XAJJBWIGQKYOHF-UHFFFAOYSA-N
ID: 72490
SMILES:c1(CC=C(C)C)c(C(O)CCCC)ccc2c1OC(C)(C)C1=C2C(O)C(C)(O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -12.058
InChIKey:DXFWALHUCSGFHG-UHFFFAOYSA-N
ID: 72491
SMILES:C12(C)CCC(=O)C3(C)C1C(OC2)c1c(cc(CCCCC)cc1O)O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -12.304
InChIKey:FBKJFFJAQJGGIY-UHFFFAOYSA-N
ID: 72492
SMILES:C(CCC)CCCc1cc2c(c(O)c1)C1C(CCC(CO)=C1)C(C)(O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -14.981
InChIKey:AEEKSBWTBCEWMP-UHFFFAOYSA-N