ID: 101641
SMILES:CCCCCCc1cc(OC(C)C2OCCC(C)=C2)c2c(c1)OC1C(=C2)COCN1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 427.585
CB1 binding score: -14.079
InChIKey:CJZWUNDYEUUTJL-UHFFFAOYSA-N
ID: 101642
SMILES:c1(O)ccccc1C1C=C(C)CCC1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.767
InChIKey:FFUBTKRHDZNPRU-UHFFFAOYSA-N
ID: 101643
SMILES:c1(C=CC)cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -18.182
InChIKey:BVHRCZARADNROI-UHFFFAOYSA-N
ID: 101644
SMILES:C1CC(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 101645
SMILES:C(=C(C)C1(OC)CC(OC)C(C)(C)OC1=O)CC(C)=CCc1c(O)c(C)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -14.279
InChIKey:KXPDILSLBZMBJG-UHFFFAOYSA-N
ID: 101646
SMILES:C1=C(C)CCC2C1c1c(cc(C(C)(CCCC)C)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -14.046
InChIKey:ZKGMCYZFAPCVFV-UHFFFAOYSA-N
ID: 101647
SMILES:CC1(C)Oc2c(c(OC(=O)C)c(OC(=O)C(C)C)cc2CC(CCCCCCCCCCCC)O)C2C=C(C)C(O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 600.837
CB1 binding score: -16.27
InChIKey:AHNXYHBAMUDTKW-UHFFFAOYSA-N
ID: 101648
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C(=O)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -18.186
InChIKey:JNZZREXYRLIYDU-UHFFFAOYSA-N
ID: 101649
SMILES:C1(C)(C)C=CCC2(C)Oc3cc(C)cc(O)c3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -16.212
InChIKey:HZXOBIJSEFXBET-UHFFFAOYSA-N
ID: 101650
SMILES:c12cc(CCCCC)cc(O)c1C1C(C(CO)(C)O1)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -15.759
InChIKey:WKFRKCGYNCEQMC-UHFFFAOYSA-N
ID: 101651
SMILES:C(O)(c1cc(O)c2c(c1)OC(C)(C)C1C2C(OC(C)=O)C(C)(O)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.438
CB1 binding score: -16.85
InChIKey:DGSUHJVMKBOXIW-UHFFFAOYSA-N
ID: 101652
SMILES:C1=C(C)CC(OC(C)=O)C2=C(c3c(O)cc(CCCCC)cc3OC1=O)CC(C(C)=C)C2OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.59
CB1 binding score: -12.681
InChIKey:CECGTAHYSWRBGD-UHFFFAOYSA-N
ID: 101653
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(CO)CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -20.193
InChIKey:JBVDVYKKJWEHPH-UHFFFAOYSA-N
ID: 101654
SMILES:CC(C)CCCc1cc2c(c(O)c1)C1C(C(C)=CCC1C(C)=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.178
InChIKey:ZRPSQHLOOFLYMW-UHFFFAOYSA-N
ID: 101655
SMILES:c1(O)c(CC2C(CCC=C(C)C)(C)O2)c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.502
InChIKey:QODRCBVKQAQONM-UHFFFAOYSA-N
ID: 101656
SMILES:C(C=C(CO)C)CC(=CCCC1(C)C=Cc2c(cc(CCCC)cc2O)O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -16.647
InChIKey:XMTWFVBMONHODI-UHFFFAOYSA-N
ID: 101657
SMILES:OC1C(CO)OC(OC2c3c(O)cc(CCCCCC)cc3CC2CCC=C(C)C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.6
CB1 binding score: -14.767
InChIKey:PNSQKKJXULPPDB-UHFFFAOYSA-N
ID: 101658
SMILES:C1(=O)C2C(C)(C3Cc4c(cc(O)cc4OC3(C)C)O2)C(C)C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -12.115
InChIKey:BBDWWBXNMKLRKX-UHFFFAOYSA-N
ID: 101659
SMILES:C(CC)CCc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 101660
SMILES:C1(C)(O)C(O)CC(C(C)=C)C(c2c(O)cc(CCCCC)cc2OC)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -16.139
InChIKey:FQCUKZOFGJMREZ-UHFFFAOYSA-N
ID: 101661
SMILES:C(CCCc1cc2c(c(O)c1)C(=O)OC1C(C)(C)CCCC1(C)O2)CCCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -15.391
InChIKey:FJFLUAHHQLGSTQ-UHFFFAOYSA-N