ID: 84778
SMILES:O(c1cc(CCCC)ccc1)C(CCC1COC(C2C=CC=C(C(O)=O)C2)=C1)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.483
CB1 binding score: -16.041
InChIKey:BXGHGIFPCJMGJX-UHFFFAOYSA-N
ID: 84779
SMILES:C1(OC)=CC(C)C2(O)C3C4(C)C(C(C)C)C(Oc5c4c(O)cc(CCCCC)c5)OC3C2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.595
CB1 binding score: -12.52
InChIKey:SONIOIHKVNWNRP-UHFFFAOYSA-N
ID: 84780
SMILES:c1cc(CO)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -16.903
InChIKey:WWPSWIHHPUFZBD-UHFFFAOYSA-N
ID: 84781
SMILES:c1(O)cc(CCCCC)c(C(O)=O)c(O)c1CC=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -19.394
InChIKey:IQDBYPKRWVDTCI-UHFFFAOYSA-N
ID: 84782
SMILES:C1CC(C)(C)C2C(C)(C1)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.783
InChIKey:KPTGTVLDBMVBEX-UHFFFAOYSA-N
ID: 84783
SMILES:CC(C(C(CC(OC)=O)CC)=O)c1c2c(ccc1O)OC(C)(C)C1C2C(C)=CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -14.104
InChIKey:XDERACXAPWVHEY-UHFFFAOYSA-N
ID: 84784
SMILES:C(C)OC(c1c(CCCCCCCC)cc2c(c1)OC1(C)C(CC(C)(C)CC1)O2)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -16.803
InChIKey:IDGZLSYPSKJYFD-UHFFFAOYSA-N
ID: 84785
SMILES:CC(=CC(c1c(O)c2c(c3c(cc2)CC(C)(C)O3)C2CC(C)=CCC21C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.556
CB1 binding score: -16.006
InChIKey:VCJNISMGYMSPEA-UHFFFAOYSA-N
ID: 84786
SMILES:CC1=CC(c2ccc(CCCCC)c(O)c2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -17.701
InChIKey:GLWWBCAZFMPOBS-UHFFFAOYSA-N
ID: 84787
SMILES:O=C1OC2(C(=O)O)Cc3c(cc(CCCCC)cc3O)OC(C)(C)C2C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.422
CB1 binding score: -17.149
InChIKey:VMBWGPWPGPEPAI-UHFFFAOYSA-N
ID: 84788
SMILES:CNCc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 301.43
CB1 binding score: -16.339
InChIKey:GSNLUUGDQORSCC-UHFFFAOYSA-N
ID: 84789
SMILES:c12cc(CCCCC)cc(O)c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 84790
SMILES:c1(CCCCC)c(C(=O)O)c(O)c2c(c1O)OC(CCC=C(C)C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -15.255
InChIKey:ZKRFCLNVPGRHRM-UHFFFAOYSA-N
ID: 84791
SMILES:C(CCCCCCC)Cc1cc(O)cc2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -16.015
InChIKey:IXZOJVHOURWXPX-UHFFFAOYSA-N
ID: 84792
SMILES:C1(C)(C)Oc2c(c(O)cc(CCC)c2)C2C1CCC1(C)C(O)CCC(=C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -16.409
InChIKey:WIJBGLVAFGDUCL-UHFFFAOYSA-N
ID: 84793
SMILES:c1(O)c(C(CCCCC)O)cc(O)c2c1OC(C)(C)C1CCC(O)(C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -15.625
InChIKey:WZVOQVGEMYVTCG-UHFFFAOYSA-N
ID: 84794
SMILES:C1(OC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2O)OC(C)C(C)C2C1CC=C2C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -12.694
InChIKey:XPOABRCFEQJHFJ-UHFFFAOYSA-N
ID: 84795
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCCO)c2)C2C1CCC1(C)OC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.139
InChIKey:QLRZPWSFOWIKMX-UHFFFAOYSA-N
ID: 84796
SMILES:CC(=CCOc1cc(CCCCC)ccc1C1(C)CCCC1(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.567
CB1 binding score: -15.507
InChIKey:HHALGMXQZCUECJ-UHFFFAOYSA-N
ID: 84797
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCCCC)cc2)C(O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.919
InChIKey:QODQCRFRCWZTNF-UHFFFAOYSA-N
ID: 84798
SMILES:CC(CC(O)C=C(C)C)=CCc1c(O)cc(CCCCCC)c(C(=O)O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -14.634
InChIKey:RHJFRVUUSCVCBM-UHFFFAOYSA-N