ID: 6595
SMILES:C(C)(C)=CCCC1(C)C=Cc2c(O)c(C(OC)=O)c(CCC)cc2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.65
InChIKey:IHRHZABEGGQAJD-UHFFFAOYSA-N
ID: 6596
SMILES:C(C(CCCC)=O)(OC(C1C(c2c(O)cc(CCCCC)cc2O)OC(CO)(C)CC1)CCC)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.653
CB1 binding score: -15.794
InChIKey:PKLOGHBTLGJWNR-UHFFFAOYSA-N
ID: 6597
SMILES:C12C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -17.624
InChIKey:SFKCWCDDXYSANA-UHFFFAOYSA-N
ID: 6598
SMILES:c1(CCCCC)c2c(c3c(c1)OC(C)(C)C1CCC(C)(O)C(O)C13)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.705
CB1 binding score: -17.134
InChIKey:IPSQCCDPQQQWLW-UHFFFAOYSA-N
ID: 6599
SMILES:C1c2c(c(C(OC)=O)c(CCCCC)cc2O)OC(C)(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.428
CB1 binding score: -13.794
InChIKey:VLODBZSYWBKGOI-UHFFFAOYSA-N
ID: 6600
SMILES:Cc1coc2c1c(O)c1c(c2COC(C)=O)CCC(C(C)=C)C1c1cc(CCCCCC)ccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.641
CB1 binding score: -13.792
InChIKey:DDZRACUOVRHKQQ-UHFFFAOYSA-N
ID: 6601
SMILES:C12C(C)(C(OC(=O)C)CCC1(C)CO)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -10.35
InChIKey:DDGORJKAABPNOS-UHFFFAOYSA-N
ID: 6602
SMILES:c1(CCCC)cc(O)c2c(c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.879
InChIKey:IXZUQKJFDLWXNQ-UHFFFAOYSA-N
ID: 6603
SMILES:C(=O)(C(C)C)c1c(C2C=C(C)CCC2C(C)=C)c(O)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -16.407
InChIKey:KMNCFRMRSWZKMQ-UHFFFAOYSA-N
ID: 6604
SMILES:c1(O)c2c(cc(CCCCCC)c1)OC(C)(CCC=C(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.824
InChIKey:SMPCYDQBPWBEGO-UHFFFAOYSA-N
ID: 6605
SMILES:C1(C(=C)C)CCC(C)=CC1Cc1c(CCCCC)cc(O)c(C(=O)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -16.248
InChIKey:XLGAYXVERJNPCI-UHFFFAOYSA-N
ID: 6606
SMILES:C(CCC)CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.354
InChIKey:OJTMRZHYTZMJKX-UHFFFAOYSA-N
ID: 6607
SMILES:C1(C)=CCCC2(C)Oc3c(c(O)cc(CCCC)c3)C(=O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -15.547
InChIKey:QMXBBCDZMUVMLX-UHFFFAOYSA-N
ID: 6608
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1=C(C(C)(C)O2)CCC(C(=O)O)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 342.435
CB1 binding score: -15.916
InChIKey:UQIWDEBISBPCSM-UHFFFAOYSA-N
ID: 6609
SMILES:C(CC(C)=CCc1c(C)cc(O)c(O)c1CCCCC)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.922
InChIKey:XQKJMIGFYZHPIK-UHFFFAOYSA-N
ID: 6610
SMILES:C(CCCCCc1cc2c(c(O)c1)C1=C(C(=O)C(C)(C)O1)C1C2CC(CCC=C(C)C)=CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.674
CB1 binding score: -15.647
InChIKey:KZDDAHAQBHQAKM-UHFFFAOYSA-N
ID: 6611
SMILES:C1(C(C)(O)C)CC2c3c(O)c(O)cc(CCCCC)c3OC2(C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -13.424
InChIKey:XVXDGQZVPJMGLU-UHFFFAOYSA-N
ID: 6612
SMILES:C1(O)C=CC(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -15.992
InChIKey:DUTGIZWVZOOFQB-UHFFFAOYSA-N
ID: 6613
SMILES:C(C(c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1)CCCCCCCCCC=CCCCCCC)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 524.83
CB1 binding score: -14.735
InChIKey:UOENJRRVGXHLCC-UHFFFAOYSA-N
ID: 6614
SMILES:C12(O)c3c(cc(CCCCC)cc3O)OC(C)(C)C1CC1C(C)(O2)CCC2C(C)(C)CCCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.721
CB1 binding score: -14.716
InChIKey:IKYWZLCRYNGPFN-UHFFFAOYSA-N
ID: 6615
SMILES:C1CC2C(CO)(C)Oc3c(cc(Br)c(C)c3)C2C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 337.257
CB1 binding score: -16.652
InChIKey:CQYLLSAGQSDXGM-UHFFFAOYSA-N