ID: 120772
SMILES:C(C)(CCC=C(C)C)C1CC=C(C)CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -17.733
InChIKey:GDJHOFOXIAXVST-UHFFFAOYSA-N
ID: 120773
SMILES:CC1=CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 120774
SMILES:C(C)(C1CCC(C)=CC1c1c(O)cc(CCCCCO)cc1OC(=O)C(C)CC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -13.165
InChIKey:WGVXZMSADGDGFJ-UHFFFAOYSA-N
ID: 120775
SMILES:C1(C)COc2cc(CCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 192.258
CB1 binding score: -18.334
InChIKey:QASDEULNINBRNY-UHFFFAOYSA-N
ID: 120776
SMILES:C(c1cc(OC)cc(O)c1)C1C=C(C)CCC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -15.668
InChIKey:JQSBSQWTOIDIRL-UHFFFAOYSA-N
ID: 120777
SMILES:CC1(O)C(CC=C(C)C)C(c2cc(CCC)ccc2O)OC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -13.934
InChIKey:WXGUVSOALGEUKG-UHFFFAOYSA-N
ID: 120778
SMILES:O1c2cc(CCCCC)cc(O)c2C2C(C(C)(C)OO)CCC(C)(OC2=O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.491
CB1 binding score: -16.099
InChIKey:WHJHEAOGYVXEGB-UHFFFAOYSA-N
ID: 120779
SMILES:c1(O)c(CC=C(C)CCC=C(C)C)c(O)c(C=O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.155
InChIKey:RYSPAXUKZYPMEQ-UHFFFAOYSA-N
ID: 120780
SMILES:C(CCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 120781
SMILES:c1(OC)c(OC)c(OC)cc(C)c1C1C=C(C)CCC1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -13.996
InChIKey:OROGHUFZLRYQPO-UHFFFAOYSA-N
ID: 120782
SMILES:CCCCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 120783
SMILES:c1c(OC)c(CC=C(C)CCC(=O)OC)c(O)c(C2C=C(C)CCC2C(C)=C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -15.929
InChIKey:ACGXHVWMHILTAF-UHFFFAOYSA-N
ID: 120784
SMILES:O1C(C)(C)C(CCC2(C)Oc3cc(C)cc(O)c3C=C2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.334
InChIKey:NVSHEMWJMDCEFC-UHFFFAOYSA-N
ID: 120785
SMILES:C(C)(OCCC1(C)Oc2c(c(OC)c(CC=CCC)c(C)c2)C=C1)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: Not available
InChIKey:MQSDEJLSPHIHAZ-UHFFFAOYSA-N
ID: 120786
SMILES:O(C)c1cc(C(=O)C)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -12.612
InChIKey:QZNHUHWKFBXCEY-UHFFFAOYSA-N
ID: 120787
SMILES:C1(C(=O)O)=CC(c2c(O)c(O)cc(CCCCC)c2)C(C(=C)C)CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -17.437
InChIKey:SXTZWXXDISXHNW-UHFFFAOYSA-N
ID: 120788
SMILES:C1C(C(C)(O)C)C(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)C1(C(=C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -16.234
InChIKey:IRTUXASCPSEQMK-UHFFFAOYSA-N
ID: 120789
SMILES:Oc1c(O)c(CC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -14.418
InChIKey:NCIHBOSVPUAHRV-UHFFFAOYSA-N
ID: 120790
SMILES:O1c2cc(CCC=C(C)C)cc(O)c2CC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -16.194
InChIKey:VNAOWBOXPITIMP-UHFFFAOYSA-N
ID: 120791
SMILES:C12C=C(C)CCC3OC3(C)CCC(C(CCC=C(C)C)C)C1c1c(cc(CCc3ccccc3)cc1O)OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 556.831
CB1 binding score: -10.778
InChIKey:VWHBQCABJCTZOA-UHFFFAOYSA-N
ID: 120792
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(cc(O)c(C)c3)C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids
MW: 272.388
CB1 binding score: -16.978
InChIKey:IHKFWARWWVKDQT-UHFFFAOYSA-N