ID: 49372
SMILES:c1(CCC)c(C(=O)O)c(O)c(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -19.667
InChIKey:FAVCTJGKHFHFHJ-UHFFFAOYSA-N
ID: 49373
SMILES:C1=C(C)CCC(C(C)=C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 49374
SMILES:C(C(C(=C)C)c1c(O)c2c3c(c1)OC(C)(C)C1CCC(C)(C31)CC2)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -14.605
InChIKey:VVPDFEAYXKJSFE-UHFFFAOYSA-N
ID: 49375
SMILES:CC(=CCc1cc(O)cc(CCC)c1)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.432
CB1 binding score: -17.917
InChIKey:BYYZHJIATPYDTN-UHFFFAOYSA-N
ID: 49376
SMILES:c12c3c(C)c4c(c1C=CC(C)(C)O2)OC(C)(C)C1C3C(C(C)(C)O4)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -12.142
InChIKey:KYVGYVCGURLBNG-UHFFFAOYSA-N
ID: 49377
SMILES:C(C)CCCc1cc(O)c(CC=C(C)CCC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.604
CB1 binding score: -20.123
InChIKey:WYEFRBILENQYOH-UHFFFAOYSA-N
ID: 49378
SMILES:COC(=O)CC(O)(O)Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.432
CB1 binding score: -17.696
InChIKey:GYRSQHSNERCIPW-UHFFFAOYSA-N
ID: 49379
SMILES:CC(OC1CC(C)(C)C2(O)C1c1c(cc(CCCCC)cc1O)OC2(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -15.116
InChIKey:AEWKGXHNLARGNM-UHFFFAOYSA-N
ID: 49380
SMILES:c1c(O)cc(CCCCC)c(C2C(C(C)C)CCC(C)=C2)c1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -18.361
InChIKey:QHPHDIRMJBCEJH-UHFFFAOYSA-N
ID: 49381
SMILES:c1(CCCCC)cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1C1OC(CO)C(O)C(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.626
CB1 binding score: -16.494
InChIKey:DWXGVKWAKIXLCD-UHFFFAOYSA-N
ID: 49382
SMILES:C1(C(C)=C)C(c2c(O)cc(CCCSC)cc2)CC(CO)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.509
CB1 binding score: -15.115
InChIKey:ZBVPKAJGBCCJML-UHFFFAOYSA-N
ID: 49383
SMILES:C12c3c(cc(CCCCC)cc3OC34C(OC(C)(C)C3)CCC(C)C4CC=C(C)C1=O)C(=O)C=C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.684
CB1 binding score: -14.6
InChIKey:YMRUUMGJCNIBLJ-UHFFFAOYSA-N
ID: 49384
SMILES:C(CCCC)c1cc2c(c(O)c1)C1CC(C)(CCC1C(C)=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 49385
SMILES:O(C(=O)C)CC1(C)C2C(C)(Oc3c(c(O)cc(CCCCC)c3)C2)C(OC(=O)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.557
CB1 binding score: -16.583
InChIKey:XDDNIUGQZPUGGH-UHFFFAOYSA-N
ID: 49386
SMILES:Oc1c(C2C=C(C)CCC2C(=C)C)c(O)c(CC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.085
InChIKey:DXSKUBRMLHRYFY-UHFFFAOYSA-N
ID: 49387
SMILES:CC(C1COC(=O)C1C)Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)OC(CC(C)C)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -14.037
InChIKey:JEBLHHARJKVYJK-UHFFFAOYSA-N
ID: 49388
SMILES:O(C(C)=O)CCC1(C)C2C(C)(Oc3cc(CCCCC)ccc32)CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -15.116
InChIKey:LYFLKZNGVPLJPQ-UHFFFAOYSA-N
ID: 49389
SMILES:C(C)(C)=CCCC(C)(C1Oc2cc(CCCCCC)cc(OC)c2C1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -16.078
InChIKey:DZCULBZGUXXDBD-UHFFFAOYSA-N
ID: 49390
SMILES:c1(-c2c3c(cc(CCCCC)c2)OC(C)(C)C2C3C=C(COC(C)=O)CC2)ccc(CC=C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.669
CB1 binding score: -15.929
InChIKey:YFLFWIWJMDJQST-UHFFFAOYSA-N
ID: 49391
SMILES:C(CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 49392
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(C)(C)O2)CC(O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N