ID: 39775
SMILES:C(Cc1c(O)cc(CCC)cc1O)=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 39776
SMILES:CC(C)(C1Cc2c(C=O)c(C3C=C(C)CCC3C(C)=C)c(O)c(CCC(=CC(CC(C)(O)C)OC(C)=O)C)c2O1)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 582.778
CB1 binding score: -13.972
InChIKey:YRHVNASDEBUJNU-UHFFFAOYSA-N
ID: 39777
SMILES:COc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 39778
SMILES:CC1(Cl)CCC2(c3c(O)cc(C)cc3OC2(C)C)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.833
CB1 binding score: -13.99
InChIKey:DHURYFYLLXFLSW-UHFFFAOYSA-N
ID: 39779
SMILES:CC1=CC2(O)C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.313
InChIKey:XIIAOXXFRJHRGJ-UHFFFAOYSA-N
ID: 39780
SMILES:c12c(cc3c(c1O)CCc1c-3c(O)cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC1O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.603
CB1 binding score: Not available
InChIKey:YLCSPSQASNMLNN-UHFFFAOYSA-N
ID: 39781
SMILES:C(C)CCCCc1cc(O)c(C2C=C(CCCC(C)=C)CCC2C=O)c(-c2cc3ccccc3o2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.68
CB1 binding score: -13.09
InChIKey:ZSPKINJIQFIGMM-UHFFFAOYSA-N
ID: 39782
SMILES:C1(O)C(C)(CCC(C(C)C)=O)Oc2c(c(O)cc(CCCCC)c2)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -18.334
InChIKey:YUYGNUZZIILJOO-UHFFFAOYSA-N
ID: 39783
SMILES:C1(=O)C2=C(C(OCCCC)O1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: Not available
InChIKey:JBIHUHRIIXFJHI-UHFFFAOYSA-N
ID: 39784
SMILES:C(OC(=O)C)C1=CC2C(CC1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -19.773
InChIKey:ILHSUWMZKIAMCQ-UHFFFAOYSA-N
ID: 39785
SMILES:CC1(C)C2CCC(C)=CC2c2c(c(C)cc(O)c2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.472
InChIKey:MRMJKDJYMLWPGM-UHFFFAOYSA-N
ID: 39786
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: 39787
SMILES:O1c2c(cc(CCCCC)cc2O)C2C(C)(C)C1(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.159
InChIKey:NOMZFOHAWOHOTG-UHFFFAOYSA-N
ID: 39788
SMILES:C1(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.026
InChIKey:FJVJQPVMJALOMF-UHFFFAOYSA-N
ID: 39789
SMILES:c1c(CCCCC)cc(O)c(C2C=C(C)CCC2C(=C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 39790
SMILES:C(CCCC)c1cc2c(c(O)c1)C1CC(C)(O2)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -18.402
InChIKey:LXADBAQHQWMXJF-UHFFFAOYSA-N
ID: 39791
SMILES:C(CCC)CCc1cc2c(c(OC)c1)C1C(C(C)(C)O2)CC(O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -13.436
InChIKey:GQAIMTSNUMBLKE-UHFFFAOYSA-N
ID: 39792
SMILES:C(CCCc1cc2c(c(O)c1)C1C(C)CCC(C(C)(O)C)C1O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.528
InChIKey:CELPMUKCCSAHLU-UHFFFAOYSA-N
ID: 39793
SMILES:CC1(C)Cc2c(O)c(C=O)c(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -14.599
InChIKey:VHQPIYVNCBYIBJ-UHFFFAOYSA-N
ID: 39794
SMILES:C12C(C3=CC(C)(C)CCC=C3C1)c1c(O)cc(C)cc1OC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -14.494
InChIKey:ULGMZDJBKDUPQM-UHFFFAOYSA-N
ID: 39795
SMILES:C(=Cc1c(O)cc(CCCCC)cc1O)(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -16.734
InChIKey:BIKKMKWQKFRJNO-UHFFFAOYSA-N