ID: 123670
SMILES:C1C2C(C=C(C(OC)=O)C1)C(C(=C)C)C(c1c(CCCCC)cc(O)cc1O)CC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -15.783
InChIKey:LQQFNJPTIMNDMT-UHFFFAOYSA-N
ID: 123671
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC1(C)C2CC2=C(O)C(=O)C(O)=C2C1=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.602
CB1 binding score: -13.633
InChIKey:SOFHPLKRHXKIMP-UHFFFAOYSA-N
ID: 123672
SMILES:C(C=C(C)C)c1c(C)c(O)c(C2(C)C(C(=C)C)OC(=O)C2)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.746
InChIKey:QVMAVFHIRRNBKC-UHFFFAOYSA-N
ID: 123673
SMILES:Oc1c(C2C(C(=C)C)CCC(C)C2)c(O)cc(CCc2cc3c(c(O)c2)OC(C)(C)C=C3)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.603
CB1 binding score: -16.938
InChIKey:BMEWCIHSZMUKFK-UHFFFAOYSA-N
ID: 123674
SMILES:O(C)c1cc(C)cc2c1-c1c(cc(O)c(CC=C)c1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.393
CB1 binding score: -15.278
InChIKey:VWCTVNKSOHPEJD-UHFFFAOYSA-N
ID: 123675
SMILES:Oc1cc(CCCCC)cc(O)c1CCCN(C)C
Pathway: Polyketides
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 265.397
CB1 binding score: -14.24
InChIKey:XZVHWNDHAGAMIM-UHFFFAOYSA-N
ID: 123676
SMILES:Cc1c(C(=O)OC)c(O)cc2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -15.929
InChIKey:XZVFNSSEQCWSPN-UHFFFAOYSA-N
ID: 123677
SMILES:Oc1c(CC=C(CCC=C(C)CCC(C(C)(C)O)OC(=O)C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.655
CB1 binding score: -15.467
InChIKey:SLIFEYMENTUMNM-UHFFFAOYSA-N
ID: 123678
SMILES:c1(C(CC(=O)OC)c2ccc(OC)cc2)cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.548
CB1 binding score: -13.67
InChIKey:XZIXGKAYPXKGEU-UHFFFAOYSA-N
ID: 123679
SMILES:O=C1C2C(C)(C(OC)(c3c(O)cc(CCCCC)cc3O)O2)CC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -13.522
InChIKey:PHEADNLZJCGIFQ-UHFFFAOYSA-N
ID: 123680
SMILES:C(c1c(O)c(OC)cc(C)c1C1C(C(=C)C)CCC(C)=C1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -13.993
InChIKey:MSPXAZJFBGSJBI-UHFFFAOYSA-N
ID: 123681
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C)C(=O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.026
InChIKey:FJVJQPVMJALOMF-UHFFFAOYSA-N
ID: 123682
SMILES:C(CC)CCCc1cc(O)c(C2CC=C(C(CCC(C)=O)C)O2)cc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.923
InChIKey:JRGRLAILPBOXHA-UHFFFAOYSA-N
ID: 123683
SMILES:c1(O)cc(CCC)cc2c1C(=O)-C1C(CC=C(C)C1=CC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.474
CB1 binding score: -16.015
InChIKey:JGNDVCGDWBPKGQ-UHFFFAOYSA-N
ID: 123684
SMILES:C1CC(C)(C)Oc2c(c(O)c(OC)c(C3C=C(C)CCC3C(=C)C)c2O)C1C(C(O)CC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.639
CB1 binding score: -16.494
InChIKey:UJAYRZORRYFDFV-UHFFFAOYSA-N
ID: 123685
SMILES:C1=Cc2c(ccc(O)c2C(C(CCCCCCCCCC)=O)C)OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -12.851
InChIKey:MELQLFUQDQOMTL-UHFFFAOYSA-N
ID: 123686
SMILES:CC(C)=CCCC(C)=CCCC(=CCc1c(O)cc(CCCCC)c(C(=O)O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -16.655
InChIKey:LULRPZYGKXLBAS-UHFFFAOYSA-N
ID: 123687
SMILES:C1c2c(c(O)cc(CCCCC)c2O)C2=C(C1=O)C(C)(C)C(CC=C(C)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -14.432
InChIKey:GYWPEIRKTIIPFJ-UHFFFAOYSA-N
ID: 123688
SMILES:C1(C)=CCCC2c3c(cccc3)OC(C)(C)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -14.605
InChIKey:WCYJKTHUZDFIAQ-UHFFFAOYSA-N
ID: 123689
SMILES:C(C)(=CCCC1=CC(c2c(OC)ccc(O)c2)C(C(=C)C)CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -14.302
InChIKey:NNNQDGUADHASQL-UHFFFAOYSA-N
ID: 123690
SMILES:C(C)(=CCc1c(O)cc(CCCCCC)cc1O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -18.06
InChIKey:DUNLYOQOJQUZRD-UHFFFAOYSA-N