ID: 108592
SMILES:C1=C(C)CC2C(C1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 108593
SMILES:c1(O)c(C2C=C(C)CCC2C(=C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 108594
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2OC)CC(C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.528
CB1 binding score: -18.883
InChIKey:KKBNGEMFBFEYQN-UHFFFAOYSA-N
ID: 108595
SMILES:C(CCC=C(C)C)(C)=CCOc1c(Oc2c(CC=C(C)C)cc(Br)c(C)c2)cc(CCCCC)cc1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 583.651
CB1 binding score: -14.51
InChIKey:ABAYXSYAWOJTFA-UHFFFAOYSA-N
ID: 108596
SMILES:C1=C(C(C)C)C(=O)C(O)=C2OC(C)(C)C3Oc4c(c(ccc4C(C)(C)C)C)CC4C3C(C4=C)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.63
CB1 binding score: -13.67
InChIKey:RHFQJELHLGQVGO-UHFFFAOYSA-N
ID: 108597
SMILES:c1c(CCCC)cc2c(c1O)C1C(CC=C(C)C1)C(C)(O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 108598
SMILES:c1(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 108599
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 108600
SMILES:C(c1c(O)c(C)c(OC)c(C2C=C(C)CCC2C(C)=C)c1)C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.195
InChIKey:JHZMAFDTMDJCAW-UHFFFAOYSA-N
ID: 108601
SMILES:OCC1CCC(C(C)C)C(c2c(OC)cc(CCCCC)cc2OC)C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.619
CB1 binding score: -17.563
InChIKey:MFCWEZFZUSKZAR-UHFFFAOYSA-N
ID: 108602
SMILES:C1(C)=CCC(C(=C)C)C(c2c(O)cc(CCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.748
InChIKey:ORIYPICUSOGUOA-UHFFFAOYSA-N
ID: 108603
SMILES:CC(O)(C1Oc2c(c(O)cc(CCCCC)c2)C1)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.732
InChIKey:KEABNGNNOKLMEH-UHFFFAOYSA-N
ID: 108604
SMILES:c12cc(CCCCC)cc(O)c1C1C=C(C)CCC1C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.454
CB1 binding score: -17.385
InChIKey:XSQXSJJCSPEKHO-UHFFFAOYSA-N
ID: 108605
SMILES:C1C(C)CCC2C1(O)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.667
InChIKey:ZSWWKGOVYSCVDQ-UHFFFAOYSA-N
ID: 108606
SMILES:C1(C)=CC2C(C(C)(C)OC3=C(O)C(=O)C4=C(O1)CCCC4C3=O)CC(C)=C[CH]2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 383.464
CB1 binding score: -12.616
InChIKey:CHMLJEDDPNNQHY-UHFFFAOYSA-N
ID: 108607
SMILES:CC1(C)C=CCC2(C)Oc3c(c(O)cc(CCCCC)c3)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.513
InChIKey:JNZAABMSKRVKJI-UHFFFAOYSA-N
ID: 108608
SMILES:c1c(C(=O)c2c(O)c(C3C(C(C)=C)CCC(C)=C3)cc(O)c2)c(O)cc(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.468
CB1 binding score: -15.924
InChIKey:IQGMUKJVKJIVDG-UHFFFAOYSA-N
ID: 108609
SMILES:CC(C1CCC(C)(O)C2Oc3cc(CCCCC)cc(O)c3C12)C(CC=C(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -16.317
InChIKey:LLORMBOLFDHOHF-UHFFFAOYSA-N
ID: 108610
SMILES:O=C(C(CC)C)OC1C(C(C)=C)C(c2ccc(CCCCC)cc2)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.913
InChIKey:HKIABHZOYSHNMB-UHFFFAOYSA-N
ID: 108611
SMILES:C(c1cc(O)c2c(c1)OC1(C)C(C2)C(C(C)(O)C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -16.436
InChIKey:RYXOBSPMSYAFNF-UHFFFAOYSA-N
ID: 108612
SMILES:CCCCCc1cc(O)c(C2C=C(CCC=C(C)C)C(=O)O2)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.32
InChIKey:IFESJQLSBVMDMJ-UHFFFAOYSA-N